============================================================================= SHIFTS, version 4.1 [X.-P. Xu and D.A. Case, Mar. 2002] ============================================================================= shifts will be computed for atoms matching ::H* found 19 rings ring int. center anis. iso. TYR 10 0.840 -52.368 5.606 21.245 -99.200 -91.000 TYR 25 0.840 -40.411 -3.680 6.177 -99.200 -91.000 PHE 26 1.000 -44.277 -6.966 -3.131 -99.200 -91.000 HIS 28 0.900 -35.991 -1.006 1.241 -99.200 -91.000 PHE 32 1.000 -32.658 -6.219 -0.320 -99.200 -91.000 TRP 35 1.040 -29.547 -4.354 -7.340 -99.200 -91.000 TRP6 35 1.020 -29.870 -3.145 -5.326 -99.200 -91.000 TYR 45 0.840 -43.471 -12.279 -1.202 -99.200 -91.000 HIS 46 0.900 -41.711 -15.703 2.577 -99.200 -91.000 HIS 54 0.900 -47.449 -7.790 12.156 -99.200 -91.000 TYR 58 0.840 -52.317 -2.787 14.189 -99.200 -91.000 PHE 64 1.000 -65.551 -6.587 18.437 -99.200 -91.000 TYR 107 0.840 -55.695 5.430 25.824 -99.200 -91.000 HIS 112 0.900 -59.853 -1.178 33.159 -99.200 -91.000 TYR 114 0.840 -57.398 -5.144 30.767 -99.200 -91.000 HIS 130 0.900 -38.379 -6.675 9.913 -99.200 -91.000 TRP 133 1.040 -32.933 -11.581 9.232 -99.200 -91.000 TRP6 133 1.020 -33.072 -10.023 7.456 -99.200 -91.000 TYR 149 0.840 -25.150 -9.117 3.957 -99.200 -91.000